Geometry & MOs

Info

ID:	345046
PubChem CID:	127268806
Reduced:	N2S2O5C16H28 (1)
Stoich.:	A2B2C5D16E28 (1)
Weight, g/mol:	356.213364
ΔH_f, kcal/mol:	-238.73
Dipole, Da:	4.26
IP(EA), eV:	-9.38(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[4-(cyclohexylmethylsulfonyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations